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4-Methyl-1,3-benzoxazole-2-thiol

4-Methyl-1,3-benzoxazole-2-thiol structure

CAS No:
93794-44-6
Formula:
C8H7NOS
Chemical Name:
4-Methyl-1,3-benzoxazole-2-thiol
Synonyms:
4-Methyl-1,3-benzoxazole-2-thiol;4-methyl-3H-1,3-benzoxazole-2-thione;4-Methylbenzoxazole-2(3H)-thione;2(3H)-Benzoxazolethione, 4-methyl-

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4-Methyl-1,3-benzoxazole-2-thiol Basic Attributes

Molecular Weight：

165.21

Exact Mass：

165.02483502

HScode：

2934999090

Characteristics

PSA：

64.83000

XLogP3：

2.42490

Density：

1.34±0.1 g/cm3

Melting Point：

92 °C

Boiling Point：

255.3±33.0 °C(Predicted)

PKA：

11.32±0.20

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:165.21
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:165.02483502
Monoisotopic Mass:165.02483502
Topological Polar Surface Area:53.4
Heavy Atom Count:11
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Methyl-1,3-benzoxazole-2-thiol

Basic Attributes
Characteristics
Safety Information
Computed Properties

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